SCHEMBL3602000

SCHEMBL3602000

Nc1ccc2c(c1)CC(N1CCOCC1)C(=O)N2

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 1/20 0.43
DRD4 P21917 1/20 0.43
TRPV1 Q8NER1 6/20 0.42
SMN1; SMN2 Q16637 2/20 0.38
GAA P10253 1/20 0.38
MAPT P10636 1/20 0.38
TSHR P16473 1/20 0.38
HTT P42858 1/20 0.38
CRBN Q96SW2 2/20 0.38
POLB P06746 1/20 0.37
ALDH1A1 P00352 4/20 0.36
KMT2A Q03164 2/20 0.36
HSD17B10 Q99714 1/20 0.36
MEN1 O00255 1/20 0.36
CYP2C19 P33261 1/20 0.36
ALOX15 P16050 1/20 0.35

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL3583049 0.90 TRPV1 (0.48) DRD2DRD4TRPV1SMN1; SMN2GAA
SCHEMBL3594463 0.88 DRD2 (0.45) DRD2DRD4SMN1; SMN2GAAMAPT
SCHEMBL3580791 0.86 TSHR (0.46) DRD2DRD4SMN1; SMN2GAAMAPT
SCHEMBL3596528 0.85 DRD2 (0.46) DRD2DRD4GAAMAPTHTT
SCHEMBL4457515 0.85 DRD2 (0.44) DRD2DRD4SMN1; SMN2GAAMAPT
SCHEMBL3602300 0.85 DRD2 (0.44) DRD2DRD4GAAMAPTTSHR
SCHEMBL3604609 0.85 TRPV1 (0.51) DRD2DRD4TRPV1SMN1; SMN2GAA
SCHEMBL3606191 0.84 DRD2 (0.43) DRD2DRD4TRPV1SMN1; SMN2GAA
SCHEMBL3601998 0.84 DRD2 (0.43) DRD2DRD4TRPV1SMN1; SMN2GAA
SCHEMBL3604336 0.83 DRD2 (0.42) DRD2DRD4TRPV1SMN1; SMN2GAA

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100016285-A1 HETEROCYCLIDENE-N-(ARYL) ACETAMIDE DERIVATIVE MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 2010-01-21 US disclosed
EP-2128157-A1 HETEROCYCLIDENE-N-(ARYL)ACETAMIDE DERIVATIVE MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 2009-12-02 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100016285-A1 HETEROCYCLIDENE-N-(ARYL) ACETAMIDE DERIVATIVE CCNY, CCND3, NSD3 DRD2 530/4885DRD4 795/4885TRPV1 2518/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.